6-[(2S)-3-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxidanyl-propoxy]-3H-1,3-benzoxazol-2-one

Systemtic Name: 6-[(2S)-3-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxidanyl-propoxy]-3H-1,3-benzoxazol-2-one Openeye Name: 6-[(2S)-3-[4-(4-chlorophenyl)piperazin-1-yl]-2-hydroxy-propoxy]-3H-1,3-benzoxazol-2-one CAS Name: 6-[(2S)-3-[4-(4-chlorophenyl)-1-piperazinyl]-2-hydroxypropoxy]-3H-1,3-benzoxazol-2-one IUPAC Name: 6-[(2S)-3-[4-(4-chlorophenyl)piperazin-1-yl]-2-hydroxypropoxy]-3H-1,3-benzoxazol-2-one Traditional Name: 6-[(2S)-3-[4-(4-chlorophenyl)piperazino]-2-hydroxy-propoxy]-3H-1,3-benzoxazol-2-one Formula: C20H22ClN3O4 MolecularWeight: 403.85938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC3=C(C=C2)NC(=O)O3)O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C[C@@H](COC2=CC3=C(C=C2)NC(=O)O3)O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H22ClN3O4/c21-14-1-3-15(4-2-14)24-9-7-23(8-10-24)12-16(25)13-27-17-5-6-18-19(11-17)28-20(26)22-18/h1-6,11,16,25H,7-10,12-13H2,(H,22,26)/t16-/m0/s1